N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepane-1-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | SA52-1161 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C21 H29 N5 O4 |
| Smiles: | CC(C)CN1CCCN(CC1c1nc(C)no1)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0719 |
| logD: | 1.7891 |
| logSw: | -2.9263 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.757 |
| InChI Key: | ZZXUSTIGECSMIF-KRWDZBQOSA-N |